O749QI0LUV
TL;DR: O749QI0LUV (CAS 79115-47-2) is a chemical compound with molecular formula C17H20N4O4S2 and molecular weight 408.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2,6-diacetamido-4-methyl-8H-[1,3]thiazolo[4,5-f][1,3]benzothiazol-4-yl)acetate
Also Known As: 5,4-d']bisthiazol-4-yl)-acetic acid ethyl ester, (2,6-Bis-acetylamino-4-methyl-4,8-dihydro-benzo(1,2-d;5,4-d')bisthiazol-4-yl)-acetic acid ethyl ester, (2,6-Bis-acetylamino-4-methyl-4,8-dihydro-benzo[1,2-d, Ethyl (2,6-bis-acetylamino-4-methyl-4,8-dihydrobenzo(1,2-d;5,4-d')bisthiazol-4-yl)acetate, ethyl 2-(2,6-diacetamido-4-methyl-8H-[1,3]thiazolo[4,5-f][1,
| Molecular Formula | C17H20N4O4S2 |
|---|---|
| Molecular Weight | 408.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.0926 |
| Heavy Atoms | 27 |
| Complexity | 582.0 |
Chemical Identifiers
| CAS Number | 79115-47-2 |
|---|---|
| SMILES | CCOC(=O)CC1(C2=C(CC3=C1N=C(S3)NC(=O)C)SC(=N2)NC(=O)C)C |
| InChIKey | IJKPAIXKAIOBHP-UHFFFAOYSA-N |
Product Overview
O749QI0LUV (CAS 79115-47-2), with molecular formula C17H20N4O4S2 and molecular weight 408.09 g/mol. IUPAC: ethyl 2-(2,6-diacetamido-4-methyl-8H-[1,3]thiazolo[4,5-f][1,3]benzothiazol-4-yl)acetate.
Chemical Property Profile of O749QI0LUV
Property Insights of O749QI0LUV
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O749QI0LUV. The TPSA of 167.0 Ų indicates high polarity, suggesting O749QI0LUV may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, O749QI0LUV has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of O749QI0LUV?
The CAS number of O749QI0LUV is 79115-47-2.
What is the molecular formula of O749QI0LUV?
The molecular formula of O749QI0LUV is C17H20N4O4S2.
What is the molecular weight of O749QI0LUV?
The molecular weight of O749QI0LUV is 408.09 g/mol.
Where can I buy O749QI0LUV?
You can request a quote for O749QI0LUV directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O749QI0LUV?
Yes, KEHONG BIO provides custom synthesis services for O749QI0LUV and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.